[3-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)oxetan-3-yl]methanol

C13H14N2O2S — CID 116887096

IUPAC[3-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)oxetan-3-yl]methanol
SMILESCc1nc(-c2ccccn2)sc1C1(CO)COC1
InChIInChI=1S/C13H14N2O2S/c1-9-11(13(6-16)7-17-8-13)18-12(15-9)10-4-2-3-5-14-10/h2-5,16H,6-8H2,1H3
InChIKeyOZTFHHMLJSNHQS-UHFFFAOYSA-N
MW262.33 g/mol
LogP1.77
Rot. Bonds3

About [3-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)oxetan-3-yl]methanol

[3-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)oxetan-3-yl]methanol (PubChem CID 116887096) has the molecular formula C13H14N2O2S and a molecular weight of 262.33 g/mol. Its IUPAC name is [3-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)oxetan-3-yl]methanol.

Molecular Properties

Compound Name[3-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)oxetan-3-yl]methanol
PubChem CID116887096
Molecular FormulaC13H14N2O2S
Molecular Weight262.33 g/mol
Exact Mass262.08
IUPAC Name[3-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)oxetan-3-yl]methanol
SMILESCc1nc(-c2ccccn2)sc1C1(CO)COC1
InChIInChI=1S/C13H14N2O2S/c1-9-11(13(6-16)7-17-8-13)18-12(15-9)10-4-2-3-5-14-10/h2-5,16H,6-8H2,1H3
InChIKeyOZTFHHMLJSNHQS-UHFFFAOYSA-N
XLogP1.77
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[1-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol
CID 116887020
4,5-dimethyl-2-pyridin-2-yl-1,3-thiazole
CID 58923237
5-bromo-4-methyl-2-pyridin-2-yl-1,3-thiazole
CID 75532062
[1-(2-pyridin-2-yl-1,3-thiazol-4-yl)cyclopropyl]methanol
CID 116890867
[3-(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)oxetan-3-yl]methanol
CID 116887101
3-amino-3-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)propanoic acid
CID 116886784
[1-[4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazol-5-yl]cyclobutyl]methanol
CID 116887023
N-benzyl-4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
CID 9138512
[1-[4-methyl-2-(1H-pyrrol-2-yl)-1,3-thiazol-5-yl]cyclobutyl]methanol
CID 136988709
N-cyclopropyl-2-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)acetamide
CID 110328901
4-ethyl-5-methyl-2-pyridin-2-yl-1,3-thiazole
CID 91387936
1-(azepan-1-yl)-2-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)ethanone
CID 110328975

Frequently Asked Questions

What is the IUPAC name of [3-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)oxetan-3-yl]methanol?
The IUPAC name of [3-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)oxetan-3-yl]methanol (CID 116887096) is [3-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)oxetan-3-yl]methanol.
What is the SMILES notation for [3-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)oxetan-3-yl]methanol?
The canonical SMILES for [3-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)oxetan-3-yl]methanol is Cc1nc(-c2ccccn2)sc1C1(CO)COC1.
What is the InChIKey of [3-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)oxetan-3-yl]methanol?
The InChIKey is OZTFHHMLJSNHQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2S/c1-9-11(13(6-16)7-17-8-13)18-12(15-9)10-4-2-3-5-14-10/h2-5,16H,6-8H2,1H3.
What are the key properties of [3-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)oxetan-3-yl]methanol?
[3-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)oxetan-3-yl]methanol has a molecular weight of 262.33 g/mol, XLogP of 1.77, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)oxetan-3-yl]methanol is sourced from PubChem (CID 116887096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).